Introduction：Basic information about CAS 59642-21-6|N-(4-Nitrobenzoyl)-beta-alanine, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | N-(4-Nitrobenzoyl)-beta-alanine |
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| CAS Number | 59642-21-6 | Molecular Weight | 238.19700 |
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| Density | 1.407 g/cm3 | Boiling Point | 533.8ºC at 760 mmHg |
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| Molecular Formula | C10H10N2O5 | Melting Point | 157-160 °C(lit.) |
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| MSDS | / | Flash Point | 276.6ºC |
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Names
| Name | 3-[(4-nitrobenzoyl)amino]propanoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.407 g/cm3 |
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| Boiling Point | 533.8ºC at 760 mmHg |
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| Melting Point | 157-160 °C(lit.) |
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| Molecular Formula | C10H10N2O5 |
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| Molecular Weight | 238.19700 |
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| Flash Point | 276.6ºC |
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| Exact Mass | 238.05900 |
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| PSA | 112.22000 |
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| LogP | 1.71340 |
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| InChIKey | PDTLZWITKYGYDN-UHFFFAOYSA-N |
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| SMILES | O=C(O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 |
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Safety Information
| Hazard Codes | F,Xn |
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| Risk Phrases | R11:Highly Flammable. R36/37/38:Irritating to eyes, respiratory system and skin . R65:Harmful: May cause lung damage if swallowed. |
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| Safety Phrases | S16-S26-S36-S62 |
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| RIDADR | UN 3295 3/PG 2 |
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| WGK Germany | 3 |
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| Packaging Group | II |
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| Hazard Class | 3 |
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| HS Code | 2922499990 |
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Customs
| HS Code | 2922499990 |
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| Summary | HS:2922499990 other amino-acids, other than those containing more than one kind of oxygen function, and their esters; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:6.5% General tariff:30.0% |
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Synonyms
| N-(4-Nitrobenzoyl)-beta-alanine |
| 3-(4-nitrobenzamido)propanoic acid |
| MFCD00009794 |
